N-(3-chlorophenyl)-2-[5-(2-methylphenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide

Systemtic Name: N-(3-chlorophenyl)-2-[5-(2-methylphenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide Openeye Name: N-(3-chlorophenyl)-2-[5-(o-tolyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide CAS Name: N-(3-chlorophenyl)-2-[5-(2-methylphenyl)-1,3-benzoxazol-2-yl]-1-pyrrolidinecarboxamide IUPAC Name: N-(3-chlorophenyl)-2-[5-(2-methylphenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide Traditional Name: N-(3-chlorophenyl)-2-[5-(o-tolyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide Formula: C25H22ClN3O2 MolecularWeight: 431.91408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC3=C(C=C2)OC(=N3)C4CCCN4C(=O)NC5=CC(=CC=C5)Cl

Isomeric SMILES

CC1=CC=CC=C1C2=CC3=C(C=C2)OC(=N3)C4CCCN4C(=O)NC5=CC(=CC=C5)Cl

InChI

InChI=1S/C25H22ClN3O2/c1-16-6-2-3-9-20(16)17-11-12-23-21(14-17)28-24(31-23)22-10-5-13-29(22)25(30)27-19-8-4-7-18(26)15-19/h2-4,6-9,11-12,14-15,22H,5,10,13H2,1H3,(H,27,30)